N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]propyl]-4-[(2-methyl-1-imidazolyl)methyl]benzamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]propyl]-4-[(2-methylimidazol-1-yl)methyl]benzamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CC2=CC=C(C=C2)C(=O)NCCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC=CN1CC2=CC=C(C=C2)C(=O)NCCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3OS/c1-17-24-12-13-26(17)15-18-3-7-20(8-4-18)22(27)25-11-2-14-28-16-19-5-9-21(23)10-6-19/h3-10,12-13H,2,11,14-16H2,1H3,(H,25,27)